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(Q76279810)
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English
19-Norcholest-4-en-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
11a-methyl-1-(6-methylheptan-2-yl)-1H,2H,3H,3aH,3bH,4H,5H,8H,9H,9aH,9bH,10H,11H-cyclopenta[a]phenanthren-7-one
1 reference
based on heuristic
inferred from SMILES
mass
370.323565964
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₄₂O
0 references
canonical SMILES
O=C1C=C2CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2CC1
0 references
isomeric SMILES
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C
0 references
found in taxon
Muricea californica
1 reference
stated in
Occurrence and seasonal variation of 19-norcholest-4-en-3-one and 3 beta-monohydroxy sterols in the Californian gorgonian, Muricea californica
Identifiers
InChI
InChI=1S/C26H42O/c1-17(2)6-5-7-18(3)24-12-13-25-23-10-8-19-16-20(27)9-11-21(19)22(23)14-15-26(24,25)4/h16-18,21-25H,5-15H2,1-4H3/t18-,21+,22-,23-,24-,25+,26-/m1/s1
0 references
InChIKey
GJQWMFNAGHAFDW-DNHZKMRASA-N
0 references
CAS Registry Number
3404-22-6
0 references
PubChem CID
3081996
0 references
ChEBI ID
166788
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
60154702
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60955603
0 references
DSSTOX compound identifier
DTXCID301383593
0 references
LIPID MAPS ID
LMST01010313
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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